Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 12/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16382688 | 0.80 | TSHR (0.44) | ALDH1A1TSHRKDM4EUSP2POLB | |
| SCHEMBL9715679 | 0.80 | AR (0.46) | ARALDH1A1TSHRHTR2AHTR2C | |
| SCHEMBL11562734 | 0.78 | POLB (0.50) | ARALDH1A1TSHRKDM4EUSP2 | |
| SCHEMBL28245840 | 0.78 | TRPV4 (0.42) | ARALDH1A1KDM4EUSP2HTR2A | |
| SCHEMBL30629031 | 0.78 | POLB (0.50) | ARALDH1A1TSHRKDM4EUSP2 | |
| SCHEMBL29863815 | 0.78 | AR (0.51) | ARALDH1A1TSHR | |
| SCHEMBL13106347 | 0.78 | AR (0.51) | ARALDH1A1TSHR | |
| SCHEMBL5163774 | 0.77 | AR (0.46) | ARALDH1A1TSHRHTR2AHTR2C | |
| SCHEMBL20567319 | 0.76 | AR (0.42) | ARALDH1A1KDM4EUSP2HTR2A | |
| SCHEMBL28201225 | 0.75 | TSHR (0.40) | ARALDH1A1TSHRKDM4EUSP2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105339355-B | Novel CYP17 inhibitor/antiandrogen | 奥赖恩公司 | 2018-02-27 | — | — | CN | disclosed |